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Related papers: Enhanced Sampling Techniques for Lattice Gauge The…

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Perturbative expansions of QCD observables in powers of $\alpha_s$ are believed to be asymptotic and non-Borel summable due to the existence of singularities in the Borel plane (renormalons). This fact is connected with the factorization of…

High Energy Physics - Lattice · Physics 2007-05-23 Antonio Pineda

A Markov chain update scheme using a machine-learned flow-based generative model is proposed for Monte Carlo sampling in lattice field theories. The generative model may be optimized (trained) to produce samples from a distribution…

High Energy Physics - Lattice · Physics 2019-09-10 M. S. Albergo , G. Kanwar , P. E. Shanahan

In this paper we show that the apparent failure of QCD lattice perturbation theory to account for Monte Carlo measurements of perturbative quantities results from choosing the bare lattice coupling constant as the expansion parameter. Using…

High Energy Physics - Lattice · Physics 2009-10-22 G. P. Lepage , P. B. Mackenzie

Coarse-graining (CG) enables molecular dynamics (MD) simulations of larger systems and longer timescales that are otherwise infeasible with atomistic models. Machine learning potentials (MLPs), with their capacity to capture many-body…

Chemical Physics · Physics 2025-12-01 Weilong Chen , Franz Görlich , Paul Fuchs , Julija Zavadlav

We test a set of lattice gauge actions for QCD that suppress small plaquette values and in this way also suppress transitions between topological sectors. This is well suited for simulations in the epsilon-regime and it is expected to help…

High Energy Physics - Lattice · Physics 2008-11-26 XLF Collaboration , W. Bietenholz , K. Jansen , K. -I. Nagai , S. Necco , L. Scorzato , S. Shcheredin

We report results of autocorrelation measurements in pure $SU(3)$ lattice gauge theory. The computations are performed on the {\sc convex spp1200} parallel platform within the {\sc canopy} programming environment. The focus of our analysis…

High Energy Physics - Lattice · Physics 2008-11-26 Terrence Draper , Constantine Nenkov , Mike Peardon

We describe an application of the linear $\de$-expansion to the calculation of correlation functions in SU(2)-Higgs lattice gauge theory. A significant advantage of the technique is that an infinite volume lattice may be used, allowing the…

High Energy Physics - Phenomenology · Physics 2007-05-23 T. S. Evans , H. F. Jones , A. Ritz

We compute hybrid static potentials in SU(2) lattice gauge theory using a multilevel algorithm and three different small lattice spacings. The resulting static potentials, which are valid for quark-antiquark separations as small as 0.05 fm,…

High Energy Physics - Lattice · Physics 2020-08-28 Carolin Riehl , Marc Wagner

The recent introduction of Machine Learning techniques, especially Normalizing Flows, for the sampling of lattice gauge theories has shed some hope on improving the sampling efficiency of the traditional Hybrid Monte Carlo (HMC) algorithm.…

High Energy Physics - Lattice · Physics 2023-09-21 David Albandea , Luigi Del Debbio , Pilar Hernández , Richard Kenway , Joe Marsh Rossney , Alberto Ramos

The free energy landscapes of several fundamental processes are characterized by high barriers separating long-lived metastable states. In order to explore these type of landscapes enhanced sampling methods are used. While many such methods…

Chemical Physics · Physics 2019-04-12 Jayashrita Debnath , Michele Invernizzi , Michele Parrinello

Automated chemical synthesis, materials fabrication, and spectroscopic physical measurements often bring forth the challenge of process trajectory optimization, i.e., discovering the time dependence of temperature, electric field, or…

Disordered Systems and Neural Networks · Physics 2022-06-28 Mani Valleti , Rama K. Vasudevan , Maxim A. Ziatdinov , Sergei V. Kalinin

Recent results have demonstrated that samplers constructed with flow-based generative models are a promising new approach for configuration generation in lattice field theory. In this paper, we present a set of training- and…

$SU(N)$ gauge theories on compact spaces have a non-trivial vacuum structure characterized by a countable set of topological sectors and their topological charge. In lattice simulations, every topological sector needs to be explored a…

High Energy Physics - Lattice · Physics 2020-08-12 Yannis Burnier , Adrien Florio , Olaf Kaczmarek , Lukas Mazur

In pure gauge SU(3) near beta = 6, weak and strong coupling expansions break down and the MC method seems to be the only practical alternative. We discuss the possibility of using a modified version of perturbation theory which relies on a…

High Energy Physics - Lattice · Physics 2007-05-23 L. Li , Y. Meurice

Hybrid Monte Carlo (HMC) simulations of lattice gauge theories with fermionic matter rely on the invertibility of the lattice Dirac operator. Near-zero modes of the latter can therefore significantly slow down the update algorithm and cause…

High Energy Physics - Lattice · Physics 2024-01-11 Tobias Rindlisbacher , Kari Rummukainen , Ahmed Salami

Calculations of topological observables in lattice gauge theories with traditional Monte Carlo algorithms have long been known to be a difficult task, owing to the effects of long autocorrelations times. Several mitigation strategies have…

High Energy Physics - Lattice · Physics 2023-10-19 Claudio Bonanno , Alessandro Nada , Davide Vadacchino

Statistical models with constrained probability distributions are abundant in machine learning. Some examples include regression models with norm constraints (e.g., Lasso), probit, many copula models, and latent Dirichlet allocation (LDA).…

Computation · Statistics 2015-06-22 Shiwei Lan , Babak Shahbaba

Flat histogram methods, such as Wang--Landau sampling, provide a means for high-throughput calculation of phase diagrams of atomistic/lattice model systems. Many parallelisation schemes with varying degrees of complexity have been proposed…

Computational Physics · Physics 2026-03-11 Hubert J. Naguszewski , Christopher D. Woodgate , David Quigley

We investigate the role of topology on the lattice determination of the $\mathrm{SU}(3)$ strong coupling renormalized via gradient flow. To deal with the topological freezing of standard local algorithms, the definition of the coupling is…

High Energy Physics - Lattice · Physics 2024-09-04 Claudio Bonanno , Jorge Luis Dasilva Golán , Massimo D'Elia , Margarita García Pérez , Andrea Giorgieri

Molecular Dynamics (MD) simulations are fundamental computational tools for the study of proteins and their free energy landscapes. However, sampling protein conformational changes through MD simulations is challenging due to the relatively…

Biomolecules · Quantitative Biology 2023-07-20 Diego E. Kleiman , Hassan Nadeem , Diwakar Shukla